SCHEMBL16981578

SCHEMBL16981578

COCCOCCOCCOCCOCCOc1ccc2c(c1)oc1c2ccc2c3cc(F)c(F)cc3oc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 2/20 0.42
▸ HDAC1 Q13547 1/20 0.39
▸ GRM4 Q14833 1/20 0.39
▸ MAOA P21397 4/20 0.38
▸ MAOB P27338 4/20 0.38
▸ ACHE P22303 3/20 0.38
▸ DYRK1A Q13627 1/20 0.37
▸ PRKDC P78527 1/20 0.36
▸ ABCG2 Q9UNQ0 3/20 0.36
▸ FGFR1 P11362 1/20 0.36
▸ FLT1 P17948 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ ABCB1 P08183 2/20 0.36
▸ ABCC1 P33527 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TSHR P16473 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16981542 0.85 ABCB1 (0.50) APPGRM4MAOAACHEABCG2
SCHEMBL16981590 0.78 ALDH2 (0.43) APPHDAC1GRM4MAOAMAOB
SCHEMBL16807705 0.73 ABCG2 (0.44) APPHDAC1GRM4MAOAMAOB
SCHEMBL16981609 0.73 CA12 (0.43) HDAC1MAOAMAOBACHEKDM4E
SCHEMBL16981574 0.73 ABCB1 (0.44) MAOBACHEABCB1
SCHEMBL16806212 0.72 ALDH2 (0.43) APPHDAC1GRM4MAOAMAOB
SCHEMBL16806125 0.71 ALDH2 (0.44) APPHDAC1GRM4MAOAMAOB
SCHEMBL16806124 0.71 ALDH2 (0.44) APPHDAC1GRM4MAOAMAOB
SCHEMBL22145656 0.71 ALDH1A1 (0.48) HDAC1MAOAMAOBACHEPRKDC
SCHEMBL16985108 0.71 ABCB1 (0.49) GRM4MAOAACHEABCB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150221876-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL FUJIFILM CORPORATION (JP) 2015-08-06 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150221876-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL OR10J3, POF1B, SLC43A1 APP 3598/4885HDAC1 1404/4885GRM4 1624/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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